4
Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=120.45162643430676 stress="-9.188242265788867 -1.682457612809743 2.3292354478608286 -1.682457612809743 -14.931993952462042 2.2308444408325583 2.3292354478608286 2.2308444408325583 -13.758790431638875" free_energy=120.45162643430676 pbc="F T T"
Mo       0.22094491       0.23171545       0.18190327     -85.39034155       0.84328385     -26.05207271
Mo       1.32183498       1.71219253      -0.07514625      84.61349694     -83.43010004      56.97126021
Mo       1.62990665      -0.21779550       1.78278197      98.89981059      95.92523342     -83.24993820
Mo       0.06210000       1.70397289       1.32702941     -98.12296598     -13.33841723      52.33075069